In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 17 | Yes |
Popular Name: 1-ethyl-N-[(1S)-2-imidazol-1-yl-1-methyl-ethyl]piperidin-4-amine 1-ethyl-N-[(1S)-2-imidazol-1-yl-…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.91 | 7.84 | -77.93 | 3 | 4 | 2 | 36 | 238.379 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.91 | 7.33 | -35.81 | 2 | 4 | 1 | 34 | 237.371 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.91 | 8.83 | -180.56 | 4 | 4 | 3 | 40 | 239.387 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.91 | 6.59 | -100.96 | 3 | 4 | 2 | 39 | 238.379 | 5 | ↓ |